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[(DTBPY)IR(COD)(BPIN)2]OTF

View entire compound with spectra: 1 NMR

[(DTBPY)IR(COD)(BPIN)2]OTF
SpectraBase Compound ID 2LjHl1xfEj2
InChI InChI=1S/C18H24N2.C8H8.2C6H12BO2.CHF3O3S.Ir/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;1-2-4-6-8-7-5-3-1;2*1-5(2)6(3,4)9-7-8-5;2-1(3,4)8(5,6)7;/h7-12H,1-6H3;1-2,7-8H2;2*1-4H3;(H,5,6,7);/q;;2*+1;;-1/p-1
InChIKey RMBQMWPOXZNMGH-UHFFFAOYSA-M
Mol Weight 967.8 g/mol
Molecular Formula C39H56B2F3IrN2O7S
Exact Mass 968.357567 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4yGE4iaWvPY
Name [(DTBPY)IR(COD)(BPIN)2]OTF
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H56B2F3IrN2O7S
InChI InChI=1S/C18H24N2.C8H8.2C6H12BO2.CHF3O3S.Ir/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;1-2-4-6-8-7-5-3-1;2*1-5(2)6(3,4)9-7-8-5;2-1(3,4)8(5,6)7;/h7-12H,1-6H3;1-2,7-8H2;2*1-4H3;(H,5,6,7);/q;;2*+1;;-1/p-1
InChIKey RMBQMWPOXZNMGH-UHFFFAOYSA-M
Literature Reference Author T.ISHIYAMA,J.TAKAGI,K.ISHIDA,N.MIYAURA,N.R.ANASTASI,J.F.HART WIG
Literature Reference Citation J.AM.CHEM.SOC.,124,390(2002)
Literature Reference DOI 10.1021/ja0173019
Solvent THF-D8
Source File Reference UWLU47787